NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 5 M 4.1060 8.3049 120.3375 54.5357 34.4285 175.4999 6 F 4.3837 7.7970 130.0145 55.9283 38.1317 173.2597 7 D 4.8873 10.3965 127.6814 54.0642 44.3478 175.3621 8 S 5.2532 8.3747 114.1277 56.7768 66.4361 173.0985 9 I 4.9270 9.1219 124.0687 59.4737 41.1548 173.9845 10 L 4.4849 8.8301 129.5784 53.1425 43.8385 175.1370 11 V 4.4708 8.8615 128.3363 62.2122 33.2530 174.7328 12 I 5.5002 9.1171 128.6124 58.3531 40.3861 173.1322 13 C 4.6201 8.3825 123.1150 58.7828 32.9723 174.4571 14 T 4.1390 8.7650 109.6232 65.5109 69.0365 177.1284 15 G 3.6624 7.9736 107.5097 45.6247 0.0000 172.7049 16 N 4.3354 8.3985 116.9091 53.6491 37.4327 174.2863 17 I 4.5211 7.5667 108.1540 59.7691 38.5626 174.4636 18 C 4.8408 7.1361 116.3555 61.3637 31.4360 176.2126 19 R 3.7272 7.7513 118.4162 59.5991 30.1917 179.2433 20 S 3.8987 7.8122 113.4587 61.0301 63.0830 174.4378 21 P 4.1491 0.0000 0.0000 65.1810 30.8986 178.7105 22 I 3.8689 7.3430 118.5072 64.2873 37.1406 178.5747 23 G 3.3759 8.0477 106.8845 47.5537 0.0000 174.9713 24 E 3.9708 8.6738 122.0822 59.5045 29.6308 179.4096 25 R 4.0046 7.9029 117.2969 58.9172 29.9794 178.9188 26 L 3.9952 8.2622 119.2413 58.0852 41.6898 179.6788 27 L 4.0750 8.1848 118.6585 57.7837 41.2640 179.9147 28 R 3.9376 7.9441 117.4230 59.0974 30.0915 178.3320 29 R 4.0646 7.6544 117.4913 59.8042 30.0569 177.8531 30 L 4.4498 7.4559 116.5097 55.3801 43.3629 177.0804 31 L 4.7859 8.1246 119.0313 52.0869 41.6907 175.2217 32 P 4.4583 0.0000 0.0000 64.3584 31.8858 177.5194 33 S 4.5781 7.9776 110.9165 58.1028 63.6905 173.7673 34 K 4.5937 7.4077 120.8944 54.7908 34.2780 176.3673 35 K 4.2856 8.3042 123.7474 56.1716 32.9360 175.8593 36 I 5.0678 8.4304 128.5186 59.9324 40.0059 174.4252 37 N 5.4298 9.2012 124.5790 50.8217 43.0906 173.2540 38 S 5.5002 8.6209 111.4010 58.6428 66.1561 172.9843 39 A 4.7953 8.2146 121.5265 51.6637 22.8807 174.8875 40 G 4.3747 8.9386 104.5791 44.9951 0.0000 174.6453 41 V 3.9638 8.6452 116.5717 62.1310 32.0153 176.4905 42 G 4.3292 8.2932 108.6422 45.2286 0.0000 172.8059 43 A 4.2644 8.0534 120.1343 51.8471 20.0252 179.8218 44 L 4.1416 8.4049 121.9278 52.7633 40.4226 175.3722 45 V 4.0345 7.7295 121.6904 64.1739 31.9746 176.0909 46 D 4.7294 8.9420 126.2996 54.6366 39.4621 173.9230 47 H 4.5754 8.0799 117.6261 55.3192 30.0333 175.2410 48 T 4.6108 8.4855 116.8900 61.5387 68.3533 173.3506 49 A 4.3282 8.5404 125.8524 51.7077 19.1561 177.2437 50 D 4.4465 8.9425 120.7485 54.2300 42.2311 177.1099 51 E 3.8848 9.0086 125.9124 59.8340 29.6173 179.5679 52 S 3.7135 8.2192 114.6770 60.9866 62.6157 176.6151 53 A 4.1558 7.7411 123.1695 55.2864 18.2346 179.4949 54 I 3.6463 7.9334 118.5941 64.3833 37.1691 178.4973 55 R 3.8143 8.0962 119.9307 59.5838 29.7932 179.0309 56 V 3.5429 7.8171 118.5587 64.4407 31.2879 178.1325 57 A 3.8152 8.0701 121.3698 55.1476 18.2676 179.4175 58 E 3.8705 8.4493 117.3694 59.3550 29.2839 179.3267 59 K 3.8067 7.7416 118.7273 59.3965 32.1585 177.4626 60 N 4.7773 7.2987 113.7911 52.5297 38.5824 175.5576 61 G 3.8731 8.0362 107.9828 46.0242 0.0000 173.3237 62 L 4.6580 8.1089 121.2036 52.8889 43.7131 175.0898 63 C 4.6706 8.6080 125.5493 57.9186 32.7638 173.0841 64 L 4.5973 8.2890 125.0599 54.2022 42.2923 176.5110 65 K 3.9034 7.7719 118.8610 58.1050 32.3533 177.2568 66 G 3.9614 8.8825 110.6772 45.2317 0.0000 173.0760 67 H 4.4897 7.5002 119.2371 56.1461 30.7868 174.6588 68 R 4.4636 7.7939 123.3484 54.1761 32.9697 174.7886 69 G 3.8479 9.1567 114.6430 47.2564 0.0000 172.2874 70 T 5.0103 9.7557 121.2016 61.4079 72.8888 172.9801 71 K 4.6275 8.6351 127.1487 55.6413 33.0723 176.1169 72 F 4.4325 8.8416 131.2836 58.5289 40.1216 174.4113 73 T 4.4417 7.1928 114.3485 58.5732 71.9599 174.7169 74 S 3.9379 8.5340 117.4151 61.5973 62.6242 176.1210 75 A 4.0618 7.7649 123.8166 54.7934 18.1866 179.1811 76 L 3.9191 7.8158 118.5911 58.2458 42.1491 179.0170 77 A 4.2254 7.7421 120.4774 55.2022 18.0733 179.5761 78 R 4.1007 7.5994 114.7133 58.4628 30.1321 177.4398 79 Q 4.2908 7.8421 116.5323 55.7517 28.9804 175.0178 80 Y 4.7666 7.7794 115.4833 56.3142 41.3823 175.2981 81 D 4.7720 8.5938 122.6444 56.1226 42.0366 176.7027 82 L 4.7388 7.9006 120.5677 53.7576 45.7038 173.9497 83 L 5.0917 8.9030 126.5117 53.0026 44.4366 175.3980 84 L 5.0815 8.6161 122.8979 53.1841 44.6358 176.0510 85 V 5.1290 8.4504 117.2419 59.1488 34.6226 177.0768 86 M 4.2038 8.6408 122.2431 57.5057 33.2857 176.4626 87 E 5.0284 8.0581 116.3634 53.9364 33.2627 176.1049 88 Y 4.1234 9.3515 120.8130 61.6336 37.6284 179.6926 89 S 4.1327 8.2068 114.1525 61.8504 62.8190 176.1172 90 H 4.6750 8.0759 120.9955 57.8617 28.3253 177.7162 91 L 3.9589 8.0383 121.4404 57.9428 41.4178 179.3655 92 E 4.0567 8.1488 117.9286 59.3820 29.2810 179.2997 93 Q 4.0124 7.7787 117.9849 58.8271 28.6546 178.6856 94 I 3.7546 7.9346 121.0653 64.3889 36.8977 178.5469 95 S 4.1094 7.9012 114.9704 61.6451 62.7512 176.5456 96 R 4.0499 8.0602 120.2978 59.3249 29.9405 178.2212 97 I 4.1715 8.1376 118.3590 62.6375 39.0175 176.4755 98 A 4.7542 8.6461 123.1703 48.5112 18.3615 174.1696 99 P 4.3556 0.0000 0.0000 65.2895 31.6414 177.8163 100 E 4.1322 8.2327 115.0228 58.2549 29.8072 177.9246 101 A 4.4954 8.2265 120.4223 52.8949 19.3774 178.8231 102 R 3.9827 7.7363 116.9943 59.3780 29.8574 178.1256 103 G 3.9660 8.0882 103.0700 45.6993 0.0000 173.6402 104 K 4.7905 8.1208 120.1644 56.7677 34.2357 175.2483 105 T 5.0033 7.7216 116.9789 62.9078 70.2699 173.8191 106 M 4.9148 8.8775 124.4547 53.2283 37.5621 174.4720 107 L 4.4597 8.3042 119.7379 54.7150 42.4640 178.4799 108 F 4.0338 9.3866 126.0469 61.0801 39.7141 176.0273 109 G 4.2943 7.9901 107.7049 44.8559 0.0000 174.8593 110 H 3.6921 7.8288 122.3822 58.3625 29.6372 175.9088 111 W 4.6024 7.3782 115.4902 56.6371 29.4229 176.1086 112 L 4.5103 7.3925 118.9767 53.5187 42.4079 176.5893 113 D 4.4292 8.8078 121.5241 57.3670 40.8886 176.9917 114 S 4.6110 7.8266 112.2844 56.9240 63.2647 173.7687 115 K 4.3883 8.5705 126.9036 58.0630 32.6752 176.1178 116 E 4.2551 7.9780 119.9344 55.6529 30.4488 176.1809 117 I 4.1992 8.1825 128.5729 59.6117 37.4235 174.2088 118 P 4.4319 0.0000 0.0000 62.1746 32.3951 175.9202 119 D 4.4619 8.4892 121.7069 53.3070 41.4171 174.3747 120 P 4.2556 0.0000 0.0000 63.1059 32.2352 175.0770 121 Y 4.5622 8.0483 121.1983 59.7472 38.7780 176.6500 122 R 3.8837 8.8544 124.6739 56.4323 28.1261 175.9812 123 M 4.4487 8.0034 118.0955 53.8201 33.3071 176.2023 124 S 4.4970 8.2812 114.6981 58.3025 65.3062 174.6225 125 D 4.4643 8.6912 122.0911 57.5863 40.6125 178.9528 126 E 4.3889 8.5030 118.6294 58.5761 29.6946 178.8839 127 A 4.0534 7.6882 122.1409 54.9828 18.3727 179.6161 128 F 3.9412 8.1402 116.1824 60.5444 38.6980 177.5305 129 D 4.4718 8.4062 118.6580 57.5591 40.5958 179.0248 130 S 4.1984 7.9920 115.0290 61.7103 62.8968 176.8570 131 V 3.5255 7.9614 120.9262 66.1187 31.1508 177.1714 132 Y 3.9607 8.4960 119.6096 60.9512 38.5653 178.0433 133 Q 4.0539 8.3423 120.2278 59.1666 29.0460 178.2731 134 L 3.9959 8.1901 120.0906 57.8732 41.6738 179.4213 135 L 4.0687 8.2492 119.3125 57.8036 41.5064 179.3399 136 E 3.8230 8.3277 119.6039 59.1903 29.7051 178.6508 137 Q 3.9509 8.3478 119.5703 59.1598 29.1278 177.9689 138 A 4.0940 8.4131 122.0990 55.2294 18.3325 179.7869 139 S 4.0812 8.4697 113.6786 61.7878 63.0116 176.9352 140 K 3.9322 8.0873 121.0726 59.7325 31.8847 179.6516 141 R 4.0818 7.7962 118.9967 58.4565 29.9823 179.1131 142 W 4.1950 8.3783 118.6692 59.7355 28.7850 178.4384 143 A 4.1020 8.2617 120.1944 55.1280 17.6970 179.1265 144 E 3.9977 8.1257 117.1479 59.5808 29.2567 179.8312 145 K 3.8981 7.6718 117.9527 58.7898 31.8123 178.1914 146 L 4.6930 7.8987 117.5881 54.8259 42.5386 177.0836 147 G 3.7507 7.6467 114.1341 45.7186 0.0000 173.8374 NUM RES H HA HB HB2 HB3 HD1 HD2 HD21 HD22 HD3 HE HE1 HE2 HE21 HE22 HE3 HG HG1 HG12 HG13 HG2 HG3 HZ 5 M 8.30 4.11 0.00 1.71 1.89 0.00 0.00 0.00 0.00 0.00 -0.57 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.68 2.25 0.00 6 F 7.80 4.38 0.00 3.21 2.99 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7 D 10.40 4.89 0.00 2.76 2.71 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 8 S 8.37 5.25 0.00 3.93 3.65 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 9 I 9.12 4.93 1.87 0.00 0.00 0.77 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.06 0.87 0.80 0.00 0.00 10 L 8.83 4.48 0.00 0.84 1.32 0.31 0.73 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.11 0.00 0.00 0.00 0.00 0.00 0.00 11 V 8.86 4.47 2.03 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.91 0.00 0.00 0.99 0.00 0.00 12 I 9.12 5.50 1.61 0.00 0.00 0.53 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.80 0.60 0.53 0.00 0.00 13 C 8.38 4.62 0.00 2.86 2.72 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 14 T 8.76 4.14 4.21 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.20 0.00 0.00 15 G 7.97 3.66 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 16 N 8.40 4.34 0.00 2.81 2.85 0.00 0.00 7.12 7.94 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 17 I 7.57 4.52 1.86 0.00 0.00 0.47 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.15 0.86 0.95 0.00 0.00 18 C 7.14 4.84 0.00 2.98 2.91 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 19 R 7.75 3.73 0.00 1.72 1.75 0.00 3.02 0.00 0.00 3.55 7.54 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.58 1.57 0.00 20 S 7.81 3.90 0.00 4.06 4.03 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 21 P 0.00 4.15 0.00 2.05 1.72 0.00 3.59 0.00 0.00 3.67 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.03 2.03 0.00 22 I 7.34 3.87 1.98 0.00 0.00 1.05 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.57 0.86 0.89 0.00 0.00 23 G 8.05 3.38 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 24 E 8.67 3.97 0.00 2.03 2.22 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.34 2.52 0.00 25 R 7.90 4.00 0.00 1.94 2.00 0.00 3.39 0.00 0.00 3.20 7.57 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.92 1.96 0.00 26 L 8.26 4.00 0.00 1.89 1.77 0.67 0.69 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.71 0.00 0.00 0.00 0.00 0.00 0.00 27 L 8.18 4.08 0.00 1.98 1.76 0.93 0.84 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.83 0.00 0.00 0.00 0.00 0.00 0.00 28 R 7.94 3.94 0.00 1.98 2.03 0.00 3.23 0.00 0.00 3.19 7.55 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.71 1.89 0.00 29 R 7.65 4.06 0.00 2.16 2.13 0.00 3.31 0.00 0.00 3.27 7.55 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.69 1.75 0.00 30 L 7.46 4.45 0.00 1.64 1.73 0.96 0.94 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.45 0.00 0.00 0.00 0.00 0.00 0.00 31 L 8.12 4.79 0.00 1.65 1.58 0.96 0.93 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.42 0.00 0.00 0.00 0.00 0.00 0.00 32 P 0.00 4.46 0.00 2.06 2.13 0.00 3.68 0.00 0.00 3.81 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.04 2.24 0.00 33 S 7.98 4.58 0.00 3.98 3.98 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 34 K 7.41 4.59 0.00 1.64 1.93 0.00 1.73 0.00 0.00 1.69 0.00 0.00 2.95 0.00 0.00 3.09 0.00 0.00 0.00 0.00 1.60 1.40 7.81 35 K 8.30 4.29 0.00 1.90 1.73 0.00 1.53 0.00 0.00 1.61 0.00 0.00 2.67 0.00 0.00 2.72 0.00 0.00 0.00 0.00 1.54 1.50 7.81 36 I 8.43 5.07 1.92 0.00 0.00 0.89 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.40 1.02 0.98 0.00 0.00 37 N 9.20 5.43 0.00 2.62 2.70 0.00 0.00 6.38 7.19 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 38 S 8.62 5.50 0.00 3.84 3.73 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 39 A 8.21 4.80 1.35 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 40 G 8.94 4.37 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 41 V 8.65 3.96 2.08 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.45 0.00 0.00 0.97 0.00 0.00 42 G 8.29 4.33 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 43 A 8.05 4.26 1.27 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 44 L 8.40 4.14 0.00 1.60 1.20 0.80 0.73 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.34 0.00 0.00 0.00 0.00 0.00 0.00 45 V 7.73 4.03 2.08 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.79 0.00 0.00 0.97 0.00 0.00 46 D 8.94 4.73 0.00 2.92 2.87 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 47 H 8.08 4.58 0.00 3.31 3.23 0.00 5.64 0.00 0.00 0.00 0.00 6.78 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 48 T 8.49 4.61 4.25 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.23 0.00 0.00 49 A 8.54 4.33 1.24 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 50 D 8.94 4.45 0.00 2.91 2.70 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 51 E 9.01 3.88 0.00 2.05 1.88 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.32 2.37 0.00 52 S 8.22 3.71 0.00 3.00 2.63 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 53 A 7.74 4.16 1.50 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 54 I 7.93 3.65 1.98 0.00 0.00 0.86 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.41 0.87 0.90 0.00 0.00 55 R 8.10 3.81 0.00 1.86 1.94 0.00 3.03 0.00 0.00 3.14 7.55 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.54 1.58 0.00 56 V 7.82 3.54 2.13 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.06 0.00 0.00 0.95 0.00 0.00 57 A 8.07 3.82 1.52 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 58 E 8.45 3.87 0.00 2.07 1.98 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.32 2.31 0.00 59 K 7.74 3.81 0.00 1.82 1.86 0.00 1.75 0.00 0.00 1.65 0.00 0.00 2.94 0.00 0.00 3.00 0.00 0.00 0.00 0.00 1.39 1.45 7.81 60 N 7.30 4.78 0.00 2.12 2.75 0.00 0.00 7.09 8.18 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 61 G 8.04 3.87 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 62 L 8.11 4.66 0.00 1.74 1.82 1.00 0.97 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.30 0.00 0.00 0.00 0.00 0.00 0.00 63 C 8.61 4.67 0.00 2.97 2.82 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 64 L 8.29 4.60 0.00 1.79 1.67 0.97 0.89 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.49 0.00 0.00 0.00 0.00 0.00 0.00 65 K 7.77 3.90 0.00 1.76 1.77 0.00 1.75 0.00 0.00 1.72 0.00 0.00 3.03 0.00 0.00 3.02 0.00 0.00 0.00 0.00 1.46 1.46 7.81 66 G 8.88 3.96 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 67 H 7.50 4.49 0.00 3.24 3.27 0.00 5.90 0.00 0.00 0.00 0.00 6.90 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 68 R 7.79 4.46 0.00 1.74 1.65 0.00 3.28 0.00 0.00 3.36 7.17 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.45 1.59 0.00 69 G 9.16 3.85 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 70 T 9.76 5.01 4.39 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.21 0.00 0.00 71 K 8.64 4.63 0.00 1.75 1.70 0.00 1.89 0.00 0.00 1.64 0.00 0.00 2.86 0.00 0.00 2.85 0.00 0.00 0.00 0.00 1.40 1.50 7.81 72 F 8.84 4.43 0.00 3.03 2.94 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 73 T 7.19 4.44 4.08 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.16 0.00 0.00 74 S 8.53 3.94 0.00 4.01 4.15 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 75 A 7.76 4.06 1.28 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 76 L 7.82 3.92 0.00 1.69 1.59 1.10 0.98 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.50 0.00 0.00 0.00 0.00 0.00 0.00 77 A 7.74 4.23 1.48 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 78 R 7.60 4.10 0.00 1.98 2.00 0.00 3.15 0.00 0.00 3.22 7.61 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.68 1.84 0.00 79 Q 7.84 4.29 0.00 1.84 1.70 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.33 6.62 0.00 0.00 0.00 0.00 0.00 2.26 2.28 0.00 80 Y 7.78 4.77 0.00 2.99 2.86 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 81 D 8.59 4.77 0.00 2.84 2.84 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 82 L 7.90 4.74 0.00 1.70 1.55 0.43 -0.06 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.96 0.00 0.00 0.00 0.00 0.00 0.00 83 L 8.90 5.09 0.00 1.62 1.45 1.03 0.59 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.72 0.00 0.00 0.00 0.00 0.00 0.00 84 L 8.62 5.08 0.00 1.52 1.52 -0.22 -0.04 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.86 0.00 0.00 0.00 0.00 0.00 0.00 85 V 8.45 5.13 1.97 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.87 0.00 0.00 0.91 0.00 0.00 86 M 8.64 4.20 0.00 2.03 2.13 0.00 0.00 0.00 0.00 0.00 1.65 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.55 2.61 0.00 87 E 8.06 5.03 0.00 1.58 1.68 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.20 2.18 0.00 88 Y 9.35 4.12 0.00 3.01 2.96 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 89 S 8.21 4.13 0.00 4.02 4.13 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 90 H 8.08 4.68 0.00 3.36 3.24 0.00 5.65 0.00 0.00 0.00 0.00 6.95 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 91 L 8.04 3.96 0.00 1.85 1.74 1.00 0.97 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.56 0.00 0.00 0.00 0.00 0.00 0.00 92 E 8.15 4.06 0.00 1.99 2.01 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.42 2.35 0.00 93 Q 7.78 4.01 0.00 2.23 2.14 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.32 6.81 0.00 0.00 0.00 0.00 0.00 2.39 2.52 0.00 94 I 7.93 3.75 1.95 0.00 0.00 0.10 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.65 0.97 0.99 0.00 0.00 95 S 7.90 4.11 0.00 4.04 3.95 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 96 R 8.06 4.05 0.00 2.00 2.13 0.00 3.27 0.00 0.00 3.24 7.55 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.67 1.69 0.00 97 I 8.14 4.17 2.17 0.00 0.00 1.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.53 0.88 1.03 0.00 0.00 98 A 8.65 4.75 1.38 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 99 P 0.00 4.36 0.00 2.19 2.15 0.00 3.63 0.00 0.00 3.83 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.14 2.38 0.00 100 E 8.23 4.13 0.00 1.94 2.04 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.33 2.45 0.00 101 A 8.23 4.50 1.44 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 102 R 7.74 3.98 0.00 2.00 2.07 0.00 3.15 0.00 0.00 3.18 7.60 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.65 1.72 0.00 103 G 8.09 3.97 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 104 K 8.12 4.79 0.00 2.10 2.09 0.00 1.51 0.00 0.00 1.74 0.00 0.00 2.89 0.00 0.00 2.99 0.00 0.00 0.00 0.00 1.53 1.45 7.81 105 T 7.72 5.00 4.33 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.13 0.00 0.00 106 M 8.88 4.91 0.00 1.90 1.91 0.00 0.00 0.00 0.00 0.00 1.62 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.46 2.43 0.00 107 L 8.30 4.46 0.00 1.50 1.47 0.31 0.63 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.36 0.00 0.00 0.00 0.00 0.00 0.00 108 F 9.39 4.03 0.00 2.91 3.09 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 109 G 7.99 4.29 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 110 H 7.83 3.69 0.00 3.02 2.41 0.00 5.94 0.00 0.00 0.00 0.00 6.99 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 111 W 7.38 4.60 0.00 3.03 2.91 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 112 L 7.39 4.51 0.00 1.90 1.60 0.97 0.92 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.58 0.00 0.00 0.00 0.00 0.00 0.00 113 D 8.81 4.43 0.00 2.67 2.74 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 114 S 7.83 4.61 0.00 3.83 3.77 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 115 K 8.57 4.39 0.00 1.74 1.65 0.00 1.69 0.00 0.00 1.54 0.00 0.00 2.71 0.00 0.00 2.69 0.00 0.00 0.00 0.00 1.60 1.38 7.81 116 E 7.98 4.26 0.00 1.96 1.89 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.28 2.45 0.00 117 I 8.18 4.20 1.80 0.00 0.00 0.94 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.26 0.94 0.82 0.00 0.00 118 P 0.00 4.43 0.00 1.88 1.96 0.00 3.63 0.00 0.00 3.74 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.00 2.07 0.00 119 D 8.49 4.46 0.00 2.62 2.57 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 120 P 0.00 4.26 0.00 0.51 1.54 0.00 3.68 0.00 0.00 3.73 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.66 1.62 0.00 121 Y 8.05 4.56 0.00 2.87 3.04 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 122 R 8.85 3.88 0.00 1.86 1.99 0.00 3.07 0.00 0.00 3.05 7.28 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.90 0.50 0.00 123 M 8.00 4.45 0.00 2.03 2.18 0.00 0.00 0.00 0.00 0.00 2.12 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.60 2.47 0.00 124 S 8.28 4.50 0.00 4.09 4.04 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 125 D 8.69 4.46 0.00 2.76 2.78 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 126 E 8.50 4.39 0.00 2.23 2.24 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.40 2.26 0.00 127 A 7.69 4.05 1.36 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 128 F 8.14 3.94 0.00 3.25 3.16 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 129 D 8.41 4.47 0.00 2.96 2.78 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 130 S 7.99 4.20 0.00 4.08 3.92 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 131 V 7.96 3.53 1.96 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.90 0.00 0.00 0.91 0.00 0.00 132 Y 8.50 3.96 0.00 3.25 3.17 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 133 Q 8.34 4.05 0.00 2.30 2.31 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.42 6.58 0.00 0.00 0.00 0.00 0.00 2.40 2.47 0.00 134 L 8.19 4.00 0.00 1.89 1.72 0.92 0.71 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.72 0.00 0.00 0.00 0.00 0.00 0.00 135 L 8.25 4.07 0.00 1.66 1.55 0.77 0.18 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.55 0.00 0.00 0.00 0.00 0.00 0.00 136 E 8.33 3.82 0.00 1.64 2.02 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.31 2.29 0.00 137 Q 8.35 3.95 0.00 2.24 2.24 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.28 6.57 0.00 0.00 0.00 0.00 0.00 2.38 2.39 0.00 138 A 8.41 4.09 1.62 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 139 S 8.47 4.08 0.00 4.16 4.02 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 140 K 8.09 3.93 0.00 1.97 1.86 0.00 1.68 0.00 0.00 1.66 0.00 0.00 2.97 0.00 0.00 3.04 0.00 0.00 0.00 0.00 1.48 1.67 7.81 141 R 7.80 4.08 0.00 1.97 1.74 0.00 3.16 0.00 0.00 3.25 7.13 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.57 1.72 0.00 142 W 8.38 4.20 0.00 3.47 3.07 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 143 A 8.26 4.10 1.39 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 144 E 8.13 4.00 0.00 2.06 1.85 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.26 2.46 0.00 145 K 7.67 3.90 0.00 1.88 1.78 0.00 1.18 0.00 0.00 1.19 0.00 0.00 2.13 0.00 0.00 2.13 0.00 0.00 0.00 0.00 0.63 0.21 7.81 146 L 7.90 4.69 0.00 1.72 1.78 0.92 0.91 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.12 0.00 0.00 0.00 0.00 0.00 0.00 147 G 7.65 3.75 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00